Mol:FL3FGAGS0003
From Metabolomics.JP
(Difference between revisions)
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| − | Copyright: ARM project http://www.metabolome.jp/ | + | Copyright: ARM project http://www.metabolome.jp/ |
| − | 36 39 0 0 0 0 0 0 0 0999 V2000 | + | 36 39 0 0 0 0 0 0 0 0999 V2000 |
| − | 2.4079 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4079 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 2.4079 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 2.4079 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1224 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1224 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8368 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8368 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.8368 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.8368 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 3.1224 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 3.1224 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6934 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6934 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.2645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.2645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9789 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9789 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1.6934 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 1.6934 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4500 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4500 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.1645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.1645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4500 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4500 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 0.9789 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 0.9789 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4500 -1.7705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4500 -1.7705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 4.5424 1.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | 4.5424 1.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -0.4500 1.2198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -0.4500 1.2198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.8144 -1.0474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.8144 -1.0474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.5111 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.5111 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 5.2109 1.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | 5.2109 1.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -1.2118 1.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -1.2118 1.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7278 0.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7278 0.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.3153 0.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.3153 0.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.5172 0.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.5172 0.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -2.7240 0.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -2.7240 0.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.1364 0.8196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.1364 0.8196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.9346 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.9346 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.0915 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.0915 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.5712 1.4732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.5712 1.4732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -5.2109 0.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -5.2109 0.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -4.7639 0.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -4.7639 0.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | -3.6887 -0.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 | + | -3.6887 -0.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 |
| − | 1 2 2 0 0 0 0 | + | 1 2 2 0 0 0 0 |
| − | 2 3 1 0 0 0 0 | + | 2 3 1 0 0 0 0 |
| − | 3 4 2 0 0 0 0 | + | 3 4 2 0 0 0 0 |
| − | 4 5 1 0 0 0 0 | + | 4 5 1 0 0 0 0 |
| − | 5 6 2 0 0 0 0 | + | 5 6 2 0 0 0 0 |
| − | 6 1 1 0 0 0 0 | + | 6 1 1 0 0 0 0 |
| − | 2 7 1 0 0 0 0 | + | 2 7 1 0 0 0 0 |
| − | 7 8 1 0 0 0 0 | + | 7 8 1 0 0 0 0 |
| − | 8 9 1 0 0 0 0 | + | 8 9 1 0 0 0 0 |
| − | 9 10 2 0 0 0 0 | + | 9 10 2 0 0 0 0 |
| − | 10 11 1 0 0 0 0 | + | 10 11 1 0 0 0 0 |
| − | 11 12 1 0 0 0 0 | + | 11 12 1 0 0 0 0 |
| − | 12 7 2 0 0 0 0 | + | 12 7 2 0 0 0 0 |
| − | 9 13 1 0 0 0 0 | + | 9 13 1 0 0 0 0 |
| − | 13 14 2 0 0 0 0 | + | 13 14 2 0 0 0 0 |
| − | 14 15 1 0 0 0 0 | + | 14 15 1 0 0 0 0 |
| − | 15 16 2 0 0 0 0 | + | 15 16 2 0 0 0 0 |
| − | 16 10 1 0 0 0 0 | + | 16 10 1 0 0 0 0 |
| − | 14 18 1 0 0 0 0 | + | 14 18 1 0 0 0 0 |
| − | 11 17 2 0 0 0 0 | + | 11 17 2 0 0 0 0 |
| − | 16 19 1 0 0 0 0 | + | 16 19 1 0 0 0 0 |
| − | 5 20 1 0 0 0 0 | + | 5 20 1 0 0 0 0 |
| − | 13 21 1 0 0 0 0 | + | 13 21 1 0 0 0 0 |
| − | 15 22 1 0 0 0 0 | + | 15 22 1 0 0 0 0 |
| − | 22 23 1 0 0 0 0 | + | 22 23 1 0 0 0 0 |
| − | 20 24 1 0 0 0 0 | + | 20 24 1 0 0 0 0 |
| − | 21 25 1 0 0 0 0 | + | 21 25 1 0 0 0 0 |
| − | 26 27 1 1 0 0 0 | + | 26 27 1 1 0 0 0 |
| − | 27 28 1 1 0 0 0 | + | 27 28 1 1 0 0 0 |
| − | 29 28 1 1 0 0 0 | + | 29 28 1 1 0 0 0 |
| − | 29 30 1 0 0 0 0 | + | 29 30 1 0 0 0 0 |
| − | 30 31 1 0 0 0 0 | + | 30 31 1 0 0 0 0 |
| − | 31 26 1 0 0 0 0 | + | 31 26 1 0 0 0 0 |
| − | 31 32 1 0 0 0 0 | + | 31 32 1 0 0 0 0 |
| − | 32 33 1 0 0 0 0 | + | 32 33 1 0 0 0 0 |
| − | 26 34 1 0 0 0 0 | + | 26 34 1 0 0 0 0 |
| − | 27 35 1 0 0 0 0 | + | 27 35 1 0 0 0 0 |
| − | 28 36 1 0 0 0 0 | + | 28 36 1 0 0 0 0 |
| − | 18 29 1 0 0 0 0 | + | 18 29 1 0 0 0 0 |
| − | S SKP 8 | + | S SKP 8 |
| − | ID FL3FGAGS0003 | + | ID FL3FGAGS0003 |
| − | KNApSAcK_ID C00013705 | + | KNApSAcK_ID C00013705 |
| − | NAME Nevadensin 7-glucoside;7-(beta-D-Glucopyranosyloxy)-5-hydroxy-6,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one | + | NAME Nevadensin 7-glucoside;7-(beta-D-Glucopyranosyloxy)-5-hydroxy-6,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one |
| − | CAS_RN 210837-37-9 | + | CAS_RN 210837-37-9 |
| − | FORMULA C24H26O12 | + | FORMULA C24H26O12 |
| − | EXACTMASS 506.142426296 | + | EXACTMASS 506.142426296 |
| − | AVERAGEMASS 506.45604 | + | AVERAGEMASS 506.45604 |
| − | SMILES C(C(C(O)4)OC(C(O)C4O)Oc(c(OC)3)c(c(c1c(O)3)OC(c(c2)ccc(OC)c2)=CC(=O)1)OC)O | + | SMILES C(C(C(O)4)OC(C(O)C4O)Oc(c(OC)3)c(c(c1c(O)3)OC(c(c2)ccc(OC)c2)=CC(=O)1)OC)O |
M END | M END | ||
| − | |||
Latest revision as of 09:00, 14 March 2009
Copyright: ARM project http://www.metabolome.jp/
36 39 0 0 0 0 0 0 0 0999 V2000
2.4079 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4079 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1224 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8368 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8368 1.3904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1224 1.8029 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6934 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9789 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6934 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4500 0.5654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1645 0.1529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1645 -0.6721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4500 -1.0846 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9789 -1.8029 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8789 0.5654 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4500 -1.7705 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5424 1.7920 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4500 1.2198 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.8144 -1.0474 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5111 -0.6451 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2109 1.4060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2118 1.6597 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7278 0.8372 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3153 0.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5172 0.3319 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7240 0.1051 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1364 0.8196 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9346 0.6106 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0915 1.1962 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5712 1.4732 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.2109 0.3542 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.7639 0.3817 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6887 -0.3079 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0 0 0 0
2 3 1 0 0 0 0
3 4 2 0 0 0 0
4 5 1 0 0 0 0
5 6 2 0 0 0 0
6 1 1 0 0 0 0
2 7 1 0 0 0 0
7 8 1 0 0 0 0
8 9 1 0 0 0 0
9 10 2 0 0 0 0
10 11 1 0 0 0 0
11 12 1 0 0 0 0
12 7 2 0 0 0 0
9 13 1 0 0 0 0
13 14 2 0 0 0 0
14 15 1 0 0 0 0
15 16 2 0 0 0 0
16 10 1 0 0 0 0
14 18 1 0 0 0 0
11 17 2 0 0 0 0
16 19 1 0 0 0 0
5 20 1 0 0 0 0
13 21 1 0 0 0 0
15 22 1 0 0 0 0
22 23 1 0 0 0 0
20 24 1 0 0 0 0
21 25 1 0 0 0 0
26 27 1 1 0 0 0
27 28 1 1 0 0 0
29 28 1 1 0 0 0
29 30 1 0 0 0 0
30 31 1 0 0 0 0
31 26 1 0 0 0 0
31 32 1 0 0 0 0
32 33 1 0 0 0 0
26 34 1 0 0 0 0
27 35 1 0 0 0 0
28 36 1 0 0 0 0
18 29 1 0 0 0 0
S SKP 8
ID FL3FGAGS0003
KNApSAcK_ID C00013705
NAME Nevadensin 7-glucoside;7-(beta-D-Glucopyranosyloxy)-5-hydroxy-6,8-dimethoxy-2-(4-methoxyphenyl)-4H-1-benzopyran-4-one
CAS_RN 210837-37-9
FORMULA C24H26O12
EXACTMASS 506.142426296
AVERAGEMASS 506.45604
SMILES C(C(C(O)4)OC(C(O)C4O)Oc(c(OC)3)c(c(c1c(O)3)OC(c(c2)ccc(OC)c2)=CC(=O)1)OC)O
M END
